1-(8-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(8-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(8-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(8-ethoxy-2,2,4-trimethyl-1-quinolinyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(8-ethoxy-2,2,4-trimethylquinolin-1-yl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(8-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-(2-pyrimidylthio)ethanone Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1N(C(C=C2C)(C)C)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

CCOC1=CC=CC2=C1N(C(C=C2C)(C)C)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C20H23N3O2S/c1-5-25-16-9-6-8-15-14(2)12-20(3,4)23(18(15)16)17(24)13-26-19-21-10-7-11-22-19/h6-12H,5,13H2,1-4H3